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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Histamine H3 receptor' and Ligand = 'BDBM50220950'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Histamine H3 receptor


(Rattus norvegicus (rat))
BDBM50220950
PNG
(CHEMBL67496)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)CN1CCOCC1
Show InChI InChI=1S/C21H29N3O/c1-2-7-17-19(9-3-1)23-20-10-5-4-8-18(20)21(17)22-11-6-12-24-13-15-25-16-14-24/h4-5,8,10H,1-3,6-7,9,11-16H2,(H,22,23)
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PC cid
PC sid
UniChem

Similars

PubMed
398n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards rat cortical Histamine H3 receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair
Histamine H3 receptor


(Homo sapiens (Human))
BDBM50220950
PNG
(CHEMBL67496)
Show SMILES C(CNc1c2CCCCCc2nc2ccccc12)CN1CCOCC1
Show InChI InChI=1S/C21H29N3O/c1-2-7-17-19(9-3-1)23-20-10-5-4-8-18(20)21(17)22-11-6-12-24-13-15-25-16-14-24/h4-5,8,10H,1-3,6-7,9,11-16H2,(H,22,23)
PDB

Reactome pathway
KEGG

UniProtKB/SwissProt

DrugBank
antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

PubMed
759n/an/an/an/an/an/an/an/a



Abbott Laboratories

Curated by ChEMBL


Assay Description
Binding affinity towards cloned human H3L receptor


Bioorg Med Chem Lett 13: 2131-5 (2003)


BindingDB Entry DOI: 10.7270/Q2K073N9
More data for this
Ligand-Target Pair